7T1T
JAK2 JH2 IN COMPLEX WITH JAK292
Summary for 7T1T
| Entry DOI | 10.2210/pdb7t1t/pdb |
| Descriptor | Tyrosine-protein kinase JAK2, (2S)-2-[({4-[(2-amino-7H-pyrrolo[2,3-d]pyrimidin-4-yl)oxy]phenyl}carbamoyl)amino]-4-phenylbutanoic acid, GLYCEROL, ... (4 entities in total) |
| Functional Keywords | pseudokinase domain, inhibitor, complex, transferase, transferase-transferase inhibitor complex, transferase-inhibitor complex, transferase/inhibitor |
| Biological source | Homo sapiens (human) |
| Total number of polymer chains | 1 |
| Total formula weight | 33659.51 |
| Authors | Ippolito, J.A.,Henry, S.,Krimmer, S.G.,Schlessinger, J.,Jorgensen, W.L. (deposition date: 2021-12-02, release date: 2022-05-25, Last modification date: 2023-10-18) |
| Primary citation | Henry, S.P.,Liosi, M.E.,Ippolito, J.A.,Cutrona, K.J.,Krimmer, S.G.,Newton, A.S.,Schlessinger, J.,Jorgensen, W.L. Conversion of a False Virtual Screen Hit into Selective JAK2 JH2 Domain Binders Using Convergent Design Strategies Acs Med.Chem.Lett., 13:819-826, 2022 Cited by DOI: 10.1021/acsmedchemlett.2c00051PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (2.08 Å) |
Structure validation
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